2-[2,3-bis(fluoranyl)-4-heptoxy-phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-heptoxy-phenyl]-5-octyl-pyrimidine Openeye Name: 2-(2,3-difluoro-4-heptoxy-phenyl)-5-octyl-pyrimidine CAS Name: 2-(2,3-difluoro-4-heptoxyphenyl)-5-octylpyrimidine IUPAC Name: 2-(2,3-difluoro-4-heptoxyphenyl)-5-octylpyrimidine Traditional Name: 2-(2,3-difluoro-4-heptoxy-phenyl)-5-octyl-pyrimidine Formula: C25H36F2N2O MolecularWeight: 418.562946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCC)F)F

InChI

InChI=1S/C25H36F2N2O/c1-3-5-7-9-10-12-14-20-18-28-25(29-19-20)21-15-16-22(24(27)23(21)26)30-17-13-11-8-6-4-2/h15-16,18-19H,3-14,17H2,1-2H3